ChemSpider 2D Image | 1-heptadecanoyl-sn-glycero-3-phosphocholine | C25H52NO7P


  • Molecular FormulaC25H52NO7P
  • Average mass509.657 Da
  • Monoisotopic mass509.348145 Da
  • ChemSpider ID24694752
  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2R)-3-(Heptadecanoyloxy)-2-hydroxypropyl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(2R)-3-(Heptadecanoyloxy)-2-hydroxypropyl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
Ethanaminium, 2-[[hydroxy[(2R)-2-hydroxy-3-[(1-oxoheptadecyl)oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
Phosphate de (2R)-3-(heptadecanoyloxy)-2-hydroxypropyle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
(2-{[(2R)-3-(heptadecanoyloxy)-2-hydroxypropyl phosphonato]oxy}ethyl)trimethylazanium
(2R)-3-(Heptadecanoyloxy)-2-hydroxypropyl 2-(trimethylazaniumyl)ethyl phosphate
1-margaroyl-GPC (17:0)
  • Miscellaneous
    • Chemical Class:

      A lysophosphatidylcholine 17:0 in which the acyl group at position 1 is 1-heptadecanoyl and the hydroxy group at position 2 is unsubstituted. ChEBI CHEBI:74340

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 1
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 2.51
ACD/BCF (pH 5.5): 65.75
ACD/KOC (pH 5.5): 1031.31
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 65.75
ACD/KOC (pH 7.4): 1031.34
Polar Surface Area: 115 Å2
Surface Tension:
Molar Volume:

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